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SMILES: FC(F)(F)C(NC(=O)CC1CCNCC1)c1ccccn1

InChI Key: InChIKey=IYPBAHHPKSYGBE-UHFFFAOYSA-N

Find this compound or compounds like it in BindingDB or PDB:
   Substructure
Similarity at least:  must be >=0.5
Exact match

Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 7 hits for monomerid = 164321   
Target/Host
(Institution)
LigandTarget/Host
Links
Ligand
Links
Trg + Lig
Links
Ki
nM
ΔG°
kcal/mole
IC50
nM
Kd
nM
EC50/IC50
nM
koff
s-1
kon
M-1s-1
pHTemp
°C
Voltage-dependent N-type calcium channel subunit alpha-1B


(Homo sapiens (Human))
BDBM164321
PNG
(US9688615, 132)
Show SMILES FC(F)(F)C(NC(=O)CC1CCNCC1)c1ccccn1
Show InChI InChI=1S/C14H18F3N3O/c15-14(16,17)13(11-3-1-2-6-19-11)20-12(21)9-10-4-7-18-8-5-10/h1-3,6,10,13,18H,4-5,7-9H2,(H,20,21)
PDB

UniProtKB/SwissProt

antibodypedia
GoogleScholar
AffyNet 
PC cid
PC sid
UniChem
US Patent
n/an/a>1.00E+4n/an/an/an/an/an/a



SRMLSC

US Patent


Assay Description
Cells were plated in 384-well, clear-bottom, black-walled, poly-D-lysine coated plates (Becton Dickinson, Franklin Lake, N.J.) 2 days prior to use in...


US Patent US9688615 (2017)


BindingDB Entry DOI: 10.7270/Q27S7KXH
More data for this
Ligand-Target Pair
Voltage-dependent N-type calcium channel subunit alpha-1B


(Homo sapiens (Human))
BDBM164321
PNG
(US9688615, 132)
Show SMILES FC(F)(F)C(NC(=O)CC1CCNCC1)c1ccccn1
Show InChI InChI=1S/C14H18F3N3O/c15-14(16,17)13(11-3-1-2-6-19-11)20-12(21)9-10-4-7-18-8-5-10/h1-3,6,10,13,18H,4-5,7-9H2,(H,20,21)
PDB

UniProtKB/SwissProt

antibodypedia
GoogleScholar
AffyNet 
PC cid
PC sid
UniChem
US Patent
n/an/a>1.00E+4n/an/an/an/an/an/a



SRMLSC

US Patent


Assay Description
Cells were plated in 384-well, clear-bottom, black-walled, poly-D-lysine coated plates (Becton Dickinson, Franklin Lake, N.J.) 2 days prior to use in...


US Patent US9688615 (2017)


BindingDB Entry DOI: 10.7270/Q27S7KXH
More data for this
Ligand-Target Pair
Voltage-dependent T-type calcium channel subunit alpha-1G


(Homo sapiens (Human))
BDBM164321
PNG
(US9688615, 132)
Show SMILES FC(F)(F)C(NC(=O)CC1CCNCC1)c1ccccn1
Show InChI InChI=1S/C14H18F3N3O/c15-14(16,17)13(11-3-1-2-6-19-11)20-12(21)9-10-4-7-18-8-5-10/h1-3,6,10,13,18H,4-5,7-9H2,(H,20,21)
PDB

NCI pathway
Reactome pathway
KEGG

UniProtKB/SwissProt

DrugBank
antibodypedia
GoogleScholar
AffyNet 
PC cid
PC sid
UniChem
US Patent
n/an/a>1.00E+4n/an/an/an/an/an/a



SRMLSC

US Patent


Assay Description
Cells were plated in 384-well, clear-bottom, black-walled, poly-D-lysine coated plates (Becton Dickinson, Franklin Lake, N.J.) 2 days prior to use in...


US Patent US9688615 (2017)


BindingDB Entry DOI: 10.7270/Q27S7KXH
More data for this
Ligand-Target Pair
Voltage-dependent L-type calcium channel subunit alpha-1C


(Homo sapiens (Human))
BDBM164321
PNG
(US9688615, 132)
Show SMILES FC(F)(F)C(NC(=O)CC1CCNCC1)c1ccccn1
Show InChI InChI=1S/C14H18F3N3O/c15-14(16,17)13(11-3-1-2-6-19-11)20-12(21)9-10-4-7-18-8-5-10/h1-3,6,10,13,18H,4-5,7-9H2,(H,20,21)
PDB

UniProtKB/SwissProt

antibodypedia
GoogleScholar
AffyNet 
PC cid
PC sid
UniChem
US Patent
n/an/a>1.00E+4n/an/an/an/a7.4n/a



SRMLSC

US Patent


Assay Description
To assess the potential cardiac liability of compounds at an early stage in the drug discovery process, a Nav1.5 sodium channel screening assay was b...


US Patent US9688615 (2017)


BindingDB Entry DOI: 10.7270/Q27S7KXH
More data for this
Ligand-Target Pair
Voltage-dependent T-type calcium channel subunit alpha-1H


(Homo sapiens (Human))
BDBM164321
PNG
(US9688615, 132)
Show SMILES FC(F)(F)C(NC(=O)CC1CCNCC1)c1ccccn1
Show InChI InChI=1S/C14H18F3N3O/c15-14(16,17)13(11-3-1-2-6-19-11)20-12(21)9-10-4-7-18-8-5-10/h1-3,6,10,13,18H,4-5,7-9H2,(H,20,21)
PDB

UniProtKB/SwissProt

antibodypedia
GoogleScholar
AffyNet 
PC cid
PC sid
UniChem
US Patent
n/an/a>1.00E+4n/an/an/an/an/an/a



SRMLSC

US Patent


Assay Description
Cells were plated in 384-well, clear-bottom, black-walled, poly-D-lysine coated plates (Becton Dickinson, Franklin Lake, N.J.) 2 days prior to use in...


US Patent US9688615 (2017)


BindingDB Entry DOI: 10.7270/Q27S7KXH
More data for this
Ligand-Target Pair
Voltage-dependent L-type calcium channel subunit alpha-1C


(Homo sapiens (Human))
BDBM164321
PNG
(US9688615, 132)
Show SMILES FC(F)(F)C(NC(=O)CC1CCNCC1)c1ccccn1
Show InChI InChI=1S/C14H18F3N3O/c15-14(16,17)13(11-3-1-2-6-19-11)20-12(21)9-10-4-7-18-8-5-10/h1-3,6,10,13,18H,4-5,7-9H2,(H,20,21)
PDB

UniProtKB/SwissProt

antibodypedia
GoogleScholar
AffyNet 
PC cid
PC sid
UniChem
US Patent
n/an/a>1.00E+4n/an/an/an/a7.4n/a



SRMLSC

US Patent


Assay Description
To assess the potential cardiac liability of compounds at an early stage in the drug discovery process, a Nav1.5 sodium channel screening assay was b...


US Patent US9688615 (2017)


BindingDB Entry DOI: 10.7270/Q27S7KXH
More data for this
Ligand-Target Pair
Voltage-dependent T-type calcium channel subunit alpha-1H


(Homo sapiens (Human))
BDBM164321
PNG
(US9688615, 132)
Show SMILES FC(F)(F)C(NC(=O)CC1CCNCC1)c1ccccn1
Show InChI InChI=1S/C14H18F3N3O/c15-14(16,17)13(11-3-1-2-6-19-11)20-12(21)9-10-4-7-18-8-5-10/h1-3,6,10,13,18H,4-5,7-9H2,(H,20,21)
PDB

UniProtKB/SwissProt

antibodypedia
GoogleScholar
AffyNet 
PC cid
PC sid
UniChem
US Patent
n/an/a>1.00E+4n/an/an/an/an/an/a



SRMLSC

US Patent


Assay Description
Cells were plated in 384-well, clear-bottom, black-walled, poly-D-lysine coated plates (Becton Dickinson, Franklin Lake, N.J.) 2 days prior to use in...


US Patent US9688615 (2017)


BindingDB Entry DOI: 10.7270/Q27S7KXH
More data for this
Ligand-Target Pair